79641-42-2
PROPANOIC ACID, 3-[[2-(3,4-DIMETHOXYPHENYL)ETHYL]AMINO]-3-OXO-, METHYL ESTER
NamePROPANOIC ACID, 3-[[2-(3,4-DIMETHOXYPHENYL)ETHYL]AMINO]-3-OXO-, METHYL ESTER
1Identification
【Name】
PROPANOIC ACID, 3-[[2-(3,4-DIMETHOXYPHENYL)ETHYL]AMINO]-3-OXO-, METHYL ESTER
【CAS】
【MDL】
MFCD11113285
【English Synonyms】
【Formula】
C14 H19 N O5
【MolWeight】
281.306
【Inchi】
InChI=1S/C14H19NO5/c1-18-11-5-4-10(8-12(11)19-2)6-7-15-13(16)9-14(17)20-3/h4-5,8H,6-7,9H2,1-3H3,(H,15,16)
【InChIKey】
InChIKey=HSNAXRMCAYLOGN-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1OC)CCNC(=O)CC(=O)OC
【MOL File】
PROPANOIC ACID, 3-[[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PROPANOIC ACID, 3-[[2-(3,4-DIMETHOXYPHENYL)ETHYL]AMINO]-3-OXO-, METHYL ESTER.cml